N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine

C9H12N6O — CID 47184942

IUPACN-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESc1cc2nnnn2nc1NCC1CCOC1
InChIInChI=1S/C9H12N6O/c1-2-9-11-13-14-15(9)12-8(1)10-5-7-3-4-16-6-7/h1-2,7H,3-6H2,(H,10,12)
InChIKeyMAVDYZPKTXFPNA-UHFFFAOYSA-N
MW220.24 g/mol
LogP-0.03
Rot. Bonds3

About N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine

N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 47184942) has the molecular formula C9H12N6O and a molecular weight of 220.24 g/mol. Its IUPAC name is N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID47184942
Molecular FormulaC9H12N6O
Molecular Weight220.24 g/mol
Exact Mass220.11
IUPAC NameN-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESc1cc2nnnn2nc1NCC1CCOC1
InChIInChI=1S/C9H12N6O/c1-2-9-11-13-14-15(9)12-8(1)10-5-7-3-4-16-6-7/h1-2,7H,3-6H2,(H,10,12)
InChIKeyMAVDYZPKTXFPNA-UHFFFAOYSA-N
XLogP-0.03
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(oxan-4-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 112731148
N-[(4-methylmorpholin-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 78986336
N-(oxolan-3-ylmethyl)-4-(tetrazol-1-yl)aniline
CID 43201828
N-(2-methyl-2-morpholin-4-ylpropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 17449664
N-[[(3S)-oxolan-3-yl]methyl]-1-phenyltetrazol-5-amine
CID 93422505
N-[(1-benzylpiperidin-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 133274813
N-(2,2-dimethylbutyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 103462537
(1S)-1-cyclohexyl-N,N-dimethyl-N'-(tetrazolo[1,5-b]pyridazin-6-yl)ethane-1,2-diamine
CID 94063941
2-N-(oxolan-3-ylmethyl)pyrazine-2,6-diamine
CID 78988857
6-N-(oxolan-3-ylmethyl)pyridine-2,6-diamine
CID 80646699
1-[(tetrazolo[1,5-b]pyridazin-6-ylamino)methyl]cyclobutan-1-ol
CID 115620433
N-[3-(4-methylpiperidin-1-yl)propyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 24590303

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine (CID 47184942) is N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine is c1cc2nnnn2nc1NCC1CCOC1.
What is the InChIKey of N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is MAVDYZPKTXFPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6O/c1-2-9-11-13-14-15(9)12-8(1)10-5-7-3-4-16-6-7/h1-2,7H,3-6H2,(H,10,12).
What are the key properties of N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 220.24 g/mol, XLogP of -0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 47184942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).